PUBCHEM-ZINC05157175
  MOE2007           3D
CORINA 3.40 0006  02.08.2006
 20 20  0  0  1  0  0  0  0  0999 V2000
    0.3200    1.6270   -0.8300 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1060    0.3770    0.0110 C   0  0  3  0  0  0  0  0  0  0  0  0
   -0.2450    0.6200    1.0210 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5000   -0.2610    0.0450 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6430    2.1710   -0.3090 C   0  0  3  0  0  0  0  0  0  0  0  0
    2.2340    2.7050   -1.0580 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4610    3.0070    0.9830 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0820    2.4080    1.9280 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4170    1.3750   -1.8930 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5100    2.3340   -0.7280 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6750   -0.8850    0.9250 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7330   -0.8120   -0.8720 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4230    0.9050    0.0950 N   0  3  0  0  0  0  0  0  0  0  0  0
    2.6240    1.1850    1.1130 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3350    0.8030   -0.3670 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7330    4.0190    0.9330 O   0  5  0  0  0  0  0  0  0  0  0  0
   -0.9270   -0.4910   -0.6070 N   0  3  0  0  0  0  0  0  0  0  0  0
   -0.7100   -0.7700   -1.5750 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8350   -0.0010   -0.6430 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0940   -1.3520   -0.0650 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  5  1  0  0  0  0
  1  9  1  0  0  0  0
  1 10  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2 17  1  0  0  0  0
  4 11  1  0  0  0  0
  4 12  1  0  0  0  0
  4 13  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  1  0  0  0  0
  5 13  1  0  0  0  0
  7  8  2  0  0  0  0
  7 16  1  0  0  0  0
 13 14  1  0  0  0  0
 13 15  1  0  0  0  0
 17 18  1  0  0  0  0
 17 19  1  0  0  0  0
 17 20  1  0  0  0  0
M  CHG  1  13   1
M  CHG  1  16  -1
M  CHG  1  17   1
M  END